Vitas-M small molecule compound
2,2-dimethyl-5-[(1E)-1-phenylprop-1-en-2-yl]-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
Catalog ID
STK758102
SMILES C/C(=C\c1ccccc1)/C1Nc2ccc3c(c2C2=C1C(=O)CC(C2)(C)C)cccc3
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C28H27NO MW 393.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27NO/c1-18(15-19-9-5-4-6-10-19)27-26-22(16-28(2,3)17-24(26)30)25-21-12-8-7-11-20(21)13-14-23(25)29-27/h4-15,27,29H,16-17H2,1-3H3/b18-15+InChIKey
QRYIBCSUDTYKPZ-OBGWFSINSA-NSynonyms
22dimethyl5((1E)1phenylprop1en2yl)2356tetrahydrobenzo(a)phenanthridin4(1H)one
22dimethyl5((E)1phenylprop1en2yl)1356tetrahydrobenzo(a)phenanthridin4one
CC(=CC1=CC=CC=C1)C2C3=C(CC(CC3=O)(C)C)C4=C(N2)C=CC5=CC=CC=C54
CC(=Cc1ccccc1)C1Nc2ccc3c(c2C2=C1C(=O)CC(C2)(C)C)cccc3
InChI=1SC28H27NOc118(151995461019)272622(1628(23)1724(26)30)252112871120(21)131423(25)2927h4152729H1617H213H3b1815+
MFCD01305572
ZINC000004475012
ZINC000004475013
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